4-[4-(4-ethoxy-1H-pyrrolo[3,4-c]pyridin-3-yl)-2-pyridinyl]morpholine

C18H20N4O2 — CID 66826994

IUPAC4-[4-(4-ethoxy-1H-pyrrolo[3,4-c]pyridin-3-yl)-2-pyridinyl]morpholine
SMILESCCOc1nccc2c1C(c1ccnc(N3CCOCC3)c1)=NC2
InChIInChI=1S/C18H20N4O2/c1-2-24-18-16-14(4-6-20-18)12-21-17(16)13-3-5-19-15(11-13)22-7-9-23-10-8-22/h3-6,11H,2,7-10,12H2,1H3
InChIKeyWPEQWBHJQMPNFV-UHFFFAOYSA-N
MW324.38 g/mol
LogP2.06
Rot. Bonds4

About 4-[4-(4-ethoxy-1H-pyrrolo[3,4-c]pyridin-3-yl)-2-pyridinyl]morpholine

4-[4-(4-ethoxy-1H-pyrrolo[3,4-c]pyridin-3-yl)-2-pyridinyl]morpholine (PubChem CID 66826994) has the molecular formula C18H20N4O2 and a molecular weight of 324.38 g/mol. Its IUPAC name is 4-[4-(4-ethoxy-1H-pyrrolo[3,4-c]pyridin-3-yl)-2-pyridinyl]morpholine.

Molecular Properties

Compound Name4-[4-(4-ethoxy-1H-pyrrolo[3,4-c]pyridin-3-yl)-2-pyridinyl]morpholine
PubChem CID66826994
Molecular FormulaC18H20N4O2
Molecular Weight324.38 g/mol
Exact Mass324.16
IUPAC Name4-[4-(4-ethoxy-1H-pyrrolo[3,4-c]pyridin-3-yl)-2-pyridinyl]morpholine
SMILESCCOc1nccc2c1C(c1ccnc(N3CCOCC3)c1)=NC2
InChIInChI=1S/C18H20N4O2/c1-2-24-18-16-14(4-6-20-18)12-21-17(16)13-3-5-19-15(11-13)22-7-9-23-10-8-22/h3-6,11H,2,7-10,12H2,1H3
InChIKeyWPEQWBHJQMPNFV-UHFFFAOYSA-N
XLogP2.06
TPSA59.84 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-[4-(4-ethoxy-1H-pyrrolo[3,4-c]pyridin-3-yl)-2-pyridinyl]morpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[4-(4-ethoxy-1H-pyrrolo[3,4-c]pyridin-3-yl)-2-pyridinyl]morpholine?
The IUPAC name of 4-[4-(4-ethoxy-1H-pyrrolo[3,4-c]pyridin-3-yl)-2-pyridinyl]morpholine (CID 66826994) is 4-[4-(4-ethoxy-1H-pyrrolo[3,4-c]pyridin-3-yl)-2-pyridinyl]morpholine.
What is the SMILES notation for 4-[4-(4-ethoxy-1H-pyrrolo[3,4-c]pyridin-3-yl)-2-pyridinyl]morpholine?
The canonical SMILES for 4-[4-(4-ethoxy-1H-pyrrolo[3,4-c]pyridin-3-yl)-2-pyridinyl]morpholine is CCOc1nccc2c1C(c1ccnc(N3CCOCC3)c1)=NC2.
What is the InChIKey of 4-[4-(4-ethoxy-1H-pyrrolo[3,4-c]pyridin-3-yl)-2-pyridinyl]morpholine?
The InChIKey is WPEQWBHJQMPNFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O2/c1-2-24-18-16-14(4-6-20-18)12-21-17(16)13-3-5-19-15(11-13)22-7-9-23-10-8-22/h3-6,11H,2,7-10,12H2,1H3.
What are the key properties of 4-[4-(4-ethoxy-1H-pyrrolo[3,4-c]pyridin-3-yl)-2-pyridinyl]morpholine?
4-[4-(4-ethoxy-1H-pyrrolo[3,4-c]pyridin-3-yl)-2-pyridinyl]morpholine has a molecular weight of 324.38 g/mol, XLogP of 2.06, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(4-ethoxy-1H-pyrrolo[3,4-c]pyridin-3-yl)-2-pyridinyl]morpholine is sourced from PubChem (CID 66826994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).